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35436-83-0 | 2-(2-Amino-4-methylpentanamido);-3-methylbutanoic acid
CAS No: 35436-83-0 Catalog No: AG003QU6 MDL No:MFCD00068371
Product Description
Catalog Number:
AG003QU6
Chemical Name:
2-(2-Amino-4-methylpentanamido);-3-methylbutanoic acid
CAS Number:
35436-83-0
Molecular Formula:
C11H22N2O3
Molecular Weight:
230.3040
MDL Number:
MFCD00068371
IUPAC Name:
2-[(2-amino-4-methylpentanoyl)amino]-3-methylbutanoic acid
InChI:
InChI=1S/C11H22N2O3/c1-6(2)5-8(12)10(14)13-9(7(3)4)11(15)16/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)
InChI Key:
MDSUKZSLOATHMH-UHFFFAOYSA-N
SMILES:
CC(CC(C(=O)NC(C(=O)O)C(C)C)N)C
NSC Number:
524458
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.163g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
230.308g/mol
Monoisotopic Mass:
230.163g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-2
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